3-[4-(4-Methyl-1-Piperazinyl)Phenyl]-9H-Pyrido[4',3':4,5]Pyrrolo[2,3-B]Pyridine-6-Carbonitrile

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Formula C22H20N6
IUPAC Name 3-[4-(4-methyl-1-piperazinyl)phenyl]-9h-pyrido[4',3':4,5]pyrrolo[2,3-b]pyridine-6-carbonitrile
Molecular Mass 368.434 g·mol−1
Heat of Formation 604.0 ± 16.7 kJ·mol−1
Dipole Moment 7.63 ± 1.08 D
Volume 442.86 Å 3
Surface Area 395.4 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 0.76 ± eV
Point Group Symmetry C1
InChIKey PVRJSOWSQUNARV-UHFFFAOYSA-N
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Elements H C N